1-[6-azanyl-2-[(3-benzamido-5-methyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-azanyl-2-[(3-benzamido-5-methyl-1-oxidanyl-1-oxidanylidene-hexan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-amino-2-[(2-benzamido-1-carboxy-4-methyl-pentyl)amino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-amino-2-[(3-benzamido-1-hydroxy-5-methyl-1-oxohexan-2-yl)amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-amino-2-[(3-benzamido-1-hydroxy-5-methyl-1-oxohexan-2-yl)amino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-amino-2-[(2-benzamido-1-carboxy-4-methyl-pentyl)amino]hexanoyl]proline Formula: C25H38N4O6 MolecularWeight: 490.59242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C(=O)O)NC(CCCCN)C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(C(=O)O)NC(CCCCN)C(=O)N1CCCC1C(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H38N4O6/c1-16(2)15-19(28-22(30)17-9-4-3-5-10-17)21(25(34)35)27-18(11-6-7-13-26)23(31)29-14-8-12-20(29)24(32)33/h3-5,9-10,16,18-21,27H,6-8,11-15,26H2,1-2H3,(H,28,30)(H,32,33)(H,34,35)